4,7-Dibromo-2-methylquinoline
Basic information
- CAS
1070879-54-7- Standard SMILES
Cc1cc(Br)c2ccc(Br)cc2n1- InChIKey
PXCIFWJRHVARGA-UHFFFAOYSA-N- Molecular formula
- C10H7Br2N
- Average molar mass
- 300.98 g/mol
- Monoisotopic mass
- 298.89452
Names & identifiers
- Preferred name
- 4,7-Dibromo-2-methylquinoline
- IUPAC
- 4,7-dibromo-2-methylquinoline
- English name
- 4,7-Dibromo-2-methylquinoline
- Molecular formula
- C10H7Br2N
- Molecular weight
- 300.98
Names & synonyms
4,7-Dibromo-2-methylquinoline1070879-54-7DTXSID10653703AKOS022889619DB-059556Quinoline, 4,7-dibromo-2-methyl-
Database identifiers
- CAS
1070879-54-7- PubChem CID
- 39346147
- DTXSID
DTXSID10653703
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Boiling point
- 355.1 · 355.1±37.0 °C(Predicted)
- Density
- 1.819 · 1.819±0.06 g/cm3(Predicted)
- pka
- 2.63 · 2.63±0.50(Predicted)
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Related reactions
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Compound notes
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